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4(eq)-(3-Benzyloxy-1-oxo-butyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane

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4(eq)-(3-Benzyloxy-1-oxo-butyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane
SpectraBase Compound ID D0VeASEwmQ2
InChI InChI=1S/C22H32O3S/c1-16-11-12-18-20(14-16)25-21(26-22(18,2)3)19(23)10-7-13-24-15-17-8-5-4-6-9-17/h4-6,8-9,16,18,20-21H,7,10-15H2,1-3H3/t16-,18-,20-,21-/m1/s1
InChIKey YJYYTSLECZJFGQ-KRZXBLKESA-N
Mol Weight 376.6 g/mol
Molecular Formula C22H32O3S
Exact Mass 376.207216 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 91T75AujTkC
Name 4(eq)-(3-Benzyloxy-1-oxo-butyl)-5,5,9(eq)-trimethyl-2-oxa-4-thia-trans-bicyclo(4.4.0)decane
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H32O3S
InChI InChI=1S/C22H32O3S/c1-16-11-12-18-20(14-16)25-21(26-22(18,2)3)19(23)10-7-13-24-15-17-8-5-4-6-9-17/h4-6,8-9,16,18,20-21H,7,10-15H2,1-3H3/t16-,18-,20-,21-/m1/s1
InChIKey YJYYTSLECZJFGQ-KRZXBLKESA-N
Instrument Name Bruker WM-250
Literature Reference S.V. Frye, E.L. Eliel, J. Am. Chem. Soc. 110, 484 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3